Effect of training data size and noise level on support vector machines virtual screening of genotoxic compounds from large compound libraries

Pankaj Kumar, Xiao Hua Ma, Xianghui Liu, Jia Jia, Han Bucong, Ying Xue, Ze-Rong Li, Sheng-Yong Yang, Yu-Quan Wei, Yu Zong Chen. Effect of training data size and noise level on support vector machines virtual screening of genotoxic compounds from large compound libraries. Journal of Computer-Aided Molecular Design, 25(5):455-467, 2011. [doi]

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